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Substance Name: Acoschimperoside P, digluco-
RN: 102338-60-3
InChIKey: SPACVBVCXDPKMC-OWWOCXQTSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C44-H68-O20

Molecular Weight

  • 917.0012
 
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Names and Synonyms

  • Acoschimperoside P, digluco-

Registry Numbers

CAS Registry Number

  • 102338-60-3

System Generated Number

  • 0102338603

Structure Descriptors

InChI

1S/C44H68O20/c1-18-36(63-40-34(53)32(51)37(27(16-46)62-40)64-39-33(52)31(50)30(49)26(15-45)61-39)38(56-5)35(54)41(58-18)60-22-8-10-42(3)21(13-22)6-7-24-23(42)9-11-43(4)29(20-12-28(48)57-17-20)25(59-19(2)47)14-44(24,43)55/h12,18,21-27,29-41,45-46,49-55H,6-11,13-17H2,1-5H3/t18-,21+,22-,23?,24?,25-,26+,27+,29-,30+,31-,32+,33+,34+,35+,36-,37+,38-,39-,40-,41-,42-,43+,44+/m0/s1

InChIKey

SPACVBVCXDPKMC-OWWOCXQTSA-N

Smiles

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 540ug/kg (0.54mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 190, 1963.